Glycoside
GD004163
Name:
NoneFormula:
C22H21O7NSmiles:
O=C1c2ccccc2-c2c1c1ccccc1c(=O)n2C[C@H](O)[C@H](O)[C@H](O)[C@H](O)COAglycone:
Cn1c2c(c3ccccc3c1=O)C(=O)c1ccccc1-2Sugarmoiety:
OCC(O)C(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.27 |
| AlogP: | -0.35 | Num_rotatable_bonds: | 6 |
| MolWt: | 411.41 | Num_heavy_atoms: | 30 |
| TPSA: | 140.22 | NumAromaticRings: | 3 |
Unique Aglycone
AD03677
Formula: C17H11O2N
Smiles:
Cn1c2c(c3ccccc3c1=O)C(=O)c1ccccc1-2| HBA: | 3 | RingCount: | 4 |
| HBD: | 0 | FractionCSP3: | 0.06 |
| AlogP: | 2.75 | Num_rotatable_bonds: | 0 |
| MolWt: | 261.28 | Num_heavy_atoms: | 20 |
| TPSA: | 39.07 | NumAromaticRings: | 3 |
